Vitas-M small molecule compound
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(6-{[(E)-{4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Catalog ID
STK674653
SMILES COc1cc(CCNC(=O)CSc2nc3c(s2)cc(cc3)/N=C/c2ccc(c(c2)[N+](=O)[O-])Sc2nnc(s2)C)ccc1OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C29H26N6O5S4 MW 666.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N6O5S4/c1-17-33-34-29(42-17)43-25-9-5-19(12-22(25)35(37)38)15-31-20-6-7-21-26(14-20)44-28(32-21)41-16-27(36)30-11-10-18-4-8-23(39-2)24(13-18)40-3/h4-9,12-15H,10-11,16H2,1-3H3,(H,30,36)/b31-15+InChIKey
FYKNLDFJHFWCSJ-IBBHUPRXSA-NSynonyms
COc1cc(CCNC(=O)CSc2nc3c(s2)cc(cc3)N=Cc2ccc(c(c2)(N+)(=O)(O))Sc2nnc(s2)C)ccc1OC
MFCD01205156
N(2(34dimethoxyphenyl)ethyl)2((6(((E)(4((5methyl134thiadiazol2yl)sulfanyl)3nitrophenyl)methylidene)amino)13benzothiazol2yl)sulfanyl)acetamide
ZINC000150361384
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